diethyl-[[2-methyl-5-oxidanyl-3-(2,3,4-trimethoxyphenyl)carbonyl-1-benzofuran-4-yl]methyl]azanium

Systemtic Name: diethyl-[[2-methyl-5-oxidanyl-3-(2,3,4-trimethoxyphenyl)carbonyl-1-benzofuran-4-yl]methyl]azanium Openeye Name: diethyl-[[5-hydroxy-2-methyl-3-(2,3,4-trimethoxybenzoyl)benzofuran-4-yl]methyl]ammonium CAS Name: diethyl-[[5-hydroxy-2-methyl-3-[oxo-(2,3,4-trimethoxyphenyl)methyl]-4-benzofuranyl]methyl]ammonium IUPAC Name: diethyl-[[5-hydroxy-2-methyl-3-(2,3,4-trimethoxybenzoyl)-1-benzofuran-4-yl]methyl]azanium Traditional Name: diethyl-[[5-hydroxy-2-methyl-3-(2,3,4-trimethoxybenzoyl)benzofuran-4-yl]methyl]ammonium Formula: C24H30NO6+ MolecularWeight: 428.4981

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Descriptors Computed from Structure

Canonical SMILES:

CC[NH+](CC)CC1=C(C=CC2=C1C(=C(O2)C)C(=O)C3=C(C(=C(C=C3)OC)OC)OC)O

Isomeric SMILES

CC[NH+](CC)CC1=C(C=CC2=C1C(=C(O2)C)C(=O)C3=C(C(=C(C=C3)OC)OC)OC)O

InChI

InChI=1S/C24H29NO6/c1-7-25(8-2)13-16-17(26)10-12-18-21(16)20(14(3)31-18)22(27)15-9-11-19(28-4)24(30-6)23(15)29-5/h9-12,26H,7-8,13H2,1-6H3/p+1